6-bromanyl-1-oxidanidyl-2-phenyl-benzotriazol-1-ium

Systemtic Name: 6-bromanyl-1-oxidanidyl-2-phenyl-benzotriazol-1-ium Openeye Name: 6-bromo-1-oxido-2-phenyl-benzotriazol-1-ium CAS Name: 6-bromo-1-oxido-2-phenylbenzotriazol-1-ium IUPAC Name: 6-bromo-1-oxido-2-phenylbenzotriazol-1-ium Traditional Name: 6-bromo-1-oxido-2-phenyl-benzotriazol-1-ium Formula: C12H8BrN3O MolecularWeight: 290.11542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=[N+]2[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=[N+]2[O-])Br

InChI

InChI=1S/C12H8BrN3O/c13-9-6-7-11-12(8-9)16(17)15(14-11)10-4-2-1-3-5-10/h1-8H